4-(cyanomethyl)-3-oxidanyl-benzenecarbonitrile

Systemtic Name: 4-(cyanomethyl)-3-oxidanyl-benzenecarbonitrile Openeye Name: 4-(cyanomethyl)-3-hydroxy-benzonitrile CAS Name: 4-(cyanomethyl)-3-hydroxybenzonitrile IUPAC Name: 4-(cyanomethyl)-3-hydroxybenzonitrile Traditional Name: 4-(cyanomethyl)-3-hydroxy-benzonitrile Formula: C9H6N2O MolecularWeight: 158.15674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)O)CC#N

Isomeric SMILES

C1=CC(=C(C=C1C#N)O)CC#N

InChI

InChI=1S/C9H6N2O/c10-4-3-8-2-1-7(6-11)5-9(8)12/h1-2,5,12H,3H2